ChemSpider 2D Image | 4-Bromo-6-nitro-1,2-dihydro-3H-indazol-3-one | C7H4BrN3O3

4-Bromo-6-nitro-1,2-dihydro-3H-indazol-3-one

  • Molecular FormulaC7H4BrN3O3
  • Average mass258.029 Da
  • Monoisotopic mass256.943604 Da
  • ChemSpider ID26464846

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3H-Indazol-3-one, 4-bromo-1,2-dihydro-6-nitro- [ACD/Index Name]
4-Brom-6-nitro-1,2-dihydro-3H-indazol-3-on [German] [ACD/IUPAC Name]
4-Bromo-6-nitro-1,2-dihydro-3H-indazol-3-one [ACD/IUPAC Name]
4-Bromo-6-nitro-1,2-dihydro-3H-indazol-3-one [French] [ACD/IUPAC Name]
3h-indazol-3-one,4-bromo-1,2-dihydro-6-nitro-
4-Bromo-3-hydroxy-6-nitroindazole
885518-63-8 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 2.1±0.1 g/cm3
Boiling Point: 506.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 260.0±28.7 °C
Index of Refraction: 1.816
Molar Refractivity: 52.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 60.65
ACD/KOC (pH 5.5): 653.55
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 23.81
ACD/KOC (pH 7.4): 256.53
Polar Surface Area: 95 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 101.5±3.0 dyne/cm
Molar Volume: 121.6±3.0 cm3

Click to predict properties on the Chemicalize site


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